Geometry & MOs

Info

ID:	411419
PubChem CID:	135084242
Reduced:	OCl2N2C11H14 (1)
Stoich.:	AB2C2D11E14 (1)
Weight, g/mol:	228.154557
ΔH_f, kcal/mol:	-38.55
Dipole, Da:	4.1
IP(EA), eV:	-10.02(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E,2R,3S)-2-methyl-3-trimethylsilylhex-4-enoate

Drug info:

PubChemData

Smile

CCCCN(C1=NC(=CC=C1)Cl)C(=O)CCl

DOS

IR

Vibrations